0 mol 16 unq 0 iso 0 dist 7.979 6.36377 5.72175 6.55076 12.7747 8.33883 4.78943 8.17898 5.05803 5.38671 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.979 6.36377 5.72175 6.55076 12.7747 8.33883 5.48395 10.6491 6.31718 5.45161 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 7.96306 5.73067 7.46414 5.47531 5.86972 9.23576 5.79134 8.80956 7.50293 7.35595 numMergedOcc 0
3 mol 38 unq 1 iso 0 dist 7.96306 5.73067 7.46414 5.47531 5.86972 9.23576 5.48241 12.4417 9.91611 8.59794 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 7.13958 9.28278 4.80675 4.99299 7.07421 6.29026 14.5776 10.1938 8.54584 11.5533 numMergedOcc 0
5 mol 227 unq 0 iso 0 dist 9.87685 9.07872 17.4802 9.99433 17.4331 9.64299 9.9474 19.7156 7.09863 7.69739 numMergedOcc 0
6 mol 234 unq 0 iso 0 dist 9.24066 7.46434 7.87385 10.5363 10.263 5.00515 13.0285 15.1742 8.41436 5.16023 numMergedOcc 0
7 mol 234 unq 1 iso 0 dist 9.24066 7.46434 7.87385 10.5363 10.263 5.00515 13.9912 16.4929 8.92474 10.2063 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 9.29888 9.13537 9.76195 4.34203 5.57184 6.83152 10.3859 15.3066 6.57393 10.8336 numMergedOcc 0
9 mol 241 unq 0 iso 0 dist 8.96917 9.10633 8.4988 11.4382 14.8242 9.72526 7.20238 12.445 7.4631 4.86437 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 9.52903 5.73834 9.78068 3.95075 7.70189 8.58088 6.48867 14.0712 6.60405 10.221 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 9.52903 5.73834 9.78068 3.95075 7.70189 8.58088 7.52881 8.81059 6.42289 9.22664 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 8.06908 9.54857 6.18571 5.09929 4.55368 7.93997 15.3806 13.6279 7.46176 14.8465 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 6.70414 9.29635 5.77904 15.5244 12.4458 6.90434 10.8075 8.35794 9.7748 13.2927 numMergedOcc 0
